ethyl 2,5-dimethyl-4-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[2-(isopropylamino)-2-oxo-ethyl]sulfanyl-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-4-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[[2-(isopropylamino)-2-keto-ethyl]thio]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N=C2SCC(=O)NC(C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N=C2SCC(=O)NC(C)C)C)C

InChI

InChI=1S/C16H21N3O3S2/c1-6-22-16(21)13-9(4)12-14(18-10(5)19-15(12)24-13)23-7-11(20)17-8(2)3/h8H,6-7H2,1-5H3,(H,17,20)